N'-cyclopropyl-3-azaspiro[5.5]undecane-3-carboximidamide

C14H25N3 — CID 55157092

IUPACN'-cyclopropyl-3-azaspiro[5.5]undecane-3-carboximidamide
SMILESN/C(=N\C1CC1)N1CCC2(CCCCC2)CC1
InChIInChI=1S/C14H25N3/c15-13(16-12-4-5-12)17-10-8-14(9-11-17)6-2-1-3-7-14/h12H,1-11H2,(H2,15,16)
InChIKeyGZHPNEGOUWBFEO-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.51
Rot. Bonds1

About N'-cyclopropyl-3-azaspiro[5.5]undecane-3-carboximidamide

N'-cyclopropyl-3-azaspiro[5.5]undecane-3-carboximidamide (PubChem CID 55157092) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is N'-cyclopropyl-3-azaspiro[5.5]undecane-3-carboximidamide.

Molecular Properties

Compound NameN'-cyclopropyl-3-azaspiro[5.5]undecane-3-carboximidamide
PubChem CID55157092
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC NameN'-cyclopropyl-3-azaspiro[5.5]undecane-3-carboximidamide
SMILESN/C(=N\C1CC1)N1CCC2(CCCCC2)CC1
InChIInChI=1S/C14H25N3/c15-13(16-12-4-5-12)17-10-8-14(9-11-17)6-2-1-3-7-14/h12H,1-11H2,(H2,15,16)
InChIKeyGZHPNEGOUWBFEO-UHFFFAOYSA-N
XLogP2.51
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-cyclopropyl-3-azaspiro[5.5]undecane-3-carboximidamide?
The IUPAC name of N'-cyclopropyl-3-azaspiro[5.5]undecane-3-carboximidamide (CID 55157092) is N'-cyclopropyl-3-azaspiro[5.5]undecane-3-carboximidamide.
What is the SMILES notation for N'-cyclopropyl-3-azaspiro[5.5]undecane-3-carboximidamide?
The canonical SMILES for N'-cyclopropyl-3-azaspiro[5.5]undecane-3-carboximidamide is N/C(=N\C1CC1)N1CCC2(CCCCC2)CC1.
What is the InChIKey of N'-cyclopropyl-3-azaspiro[5.5]undecane-3-carboximidamide?
The InChIKey is GZHPNEGOUWBFEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c15-13(16-12-4-5-12)17-10-8-14(9-11-17)6-2-1-3-7-14/h12H,1-11H2,(H2,15,16).
What are the key properties of N'-cyclopropyl-3-azaspiro[5.5]undecane-3-carboximidamide?
N'-cyclopropyl-3-azaspiro[5.5]undecane-3-carboximidamide has a molecular weight of 235.37 g/mol, XLogP of 2.51, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-3-azaspiro[5.5]undecane-3-carboximidamide is sourced from PubChem (CID 55157092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).